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1,3-bis(benzotriazol-1-ylmethyl)-1,3-dimethylurea

View entire compound with spectra: 1 NMR

1,3-bis(benzotriazol-1-ylmethyl)-1,3-dimethylurea
SpectraBase Compound ID AFY58QbGxMl
InChI InChI=1S/C17H18N8O/c1-22(11-24-15-9-5-3-7-13(15)18-20-24)17(26)23(2)12-25-16-10-6-4-8-14(16)19-21-25/h3-10H,11-12H2,1-2H3
InChIKey KNRQVIAFZRXPNY-UHFFFAOYSA-N
Mol Weight 350.39 g/mol
Molecular Formula C17H18N8O
Exact Mass 350.160357 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LTSbO53Ok4h
Name 1,3-bis(benzotriazol-1-ylmethyl)-1,3-dimethylurea
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H18N8O
InChI InChI=1S/C17H18N8O/c1-22(11-24-15-9-5-3-7-13(15)18-20-24)17(26)23(2)12-25-16-10-6-4-8-14(16)19-21-25/h3-10H,11-12H2,1-2H3
InChIKey KNRQVIAFZRXPNY-UHFFFAOYSA-N
Literature Reference Author A.R.KATRITZKY,G.YAO,X.LAN,X.ZHAO
Literature Reference Citation J.ORG.CHEM.,58,2086(1993)
Literature Reference DOI 10.1021/jo00060a025
Molecular Weight 350.383 g/mol
Solvent CDCl3
Source File Reference UWCS22542